Methyl 2-aminohexanoate
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Basic information
- CAS
51220-79-2- Standard SMILES
CCCCC(N)C(=O)OC- InChIKey
TVZNFYXAPXOARC-UHFFFAOYSA-N- Molecular formula
- C7H15NO2
- Average molar mass
- 145.2 g/mol
- Monoisotopic mass
- 145.11027872
Overview
Dl-norleucine methyl ester is an alpha-amino acid ester.
Names & identifiers
- Preferred name
- Methyl 2-aminohexanoate
- IUPAC
- methyl 2-aminohexanoate
- English name
- DL-NORLEUCINE METHYL ESTER
- Molecular formula
- C7H15NO2
- Molecular weight
- 145.2
Names & synonyms
Methyl 2-aminohexanoate51220-79-2DL-NORLEUCINE METHYL ESTERDL-Norleucine, methyl esterMethyl 2-aminohexanoate #Methyl2-aminohexanoateMethyl DL-norleucinateaminocaproic acid methylesterSCHEMBL628944SCHEMBL7294641CHEMBL3334632SCHEMBL10367286
Show more names
Norleucine, methyl ester
CHEBI:184043TVZNFYXAPXOARC-UHFFFAOYSA-NDTXSID201370145AT44916DB-187122EN300-135670
Database identifiers
- CAS
51220-79-2- PubChem CID
- 559296
- DTXSID
DTXSID201370145- ChEMBL
CHEMBL3334632- ChEBI
CHEBI:184043- Nikkaji
- J1.329.641C
Properties
Computed structural propertiesFilling in
- XLogP
- 1
- Topological polar surface area
- 52.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 104
Physicochemical properties
- Boiling point
- 175.4 · 175.4±13.0 °C(Predicted)
- Density
- 0.957 · 0.957±0.06 g/cm3(Predicted)
- pka
- 7.92 · 7.92±0.35(Predicted)
Chemistry & industry
Additional notes
DefinitionChEBI: Dl-norleucine methyl ester is an alpha-amino acid ester.
Related reactions
16 records
Compound notes
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